[2-[(2-tert-butyl-6-methyl-phenyl)-(chloromethyl)amino]-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[(2-tert-butyl-6-methyl-phenyl)-(chloromethyl)amino]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[2-tert-butyl-N-(chloromethyl)-6-methyl-anilino]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[2-tert-butyl-N-(chloromethyl)-6-methylanilino]-2-oxoethyl] ester IUPAC Name: [2-[2-tert-butyl-N-(chloromethyl)-6-methylanilino]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[2-tert-butyl-N-(chloromethyl)-6-methyl-anilino]-2-keto-ethyl] ester Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)N(CCl)C(=O)COC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)N(CCl)C(=O)COC(=O)C

InChI

InChI=1S/C16H22ClNO3/c1-11-7-6-8-13(16(3,4)5)15(11)18(10-17)14(20)9-21-12(2)19/h6-8H,9-10H2,1-5H3